Cas no 61435-06-1 (Ethanone, 1-[3-(3-nitrophenoxy)phenyl]-)
61435-06-1 structure
Product Name:Ethanone, 1-[3-(3-nitrophenoxy)phenyl]-
CAS No:61435-06-1
MF:C14H11NO4
MW:257.241443872452
CID:479610
PubChem ID:71395918
Update Time:2025-04-19
Ethanone, 1-[3-(3-nitrophenoxy)phenyl]- Chemical and Physical Properties
Names and Identifiers
-
- Ethanone, 1-[3-(3-nitrophenoxy)phenyl]-
- 1-[3-(3-nitrophenoxy)phenyl]ethanone
- DTXSID00817514
- 61435-06-1
- AKOS017718917
- 1-[3-(3-Nitrophenoxy)phenyl]ethan-1-one
-
- Inchi: 1S/C14H11NO4/c1-10(16)11-4-2-6-13(8-11)19-14-7-3-5-12(9-14)15(17)18/h2-9H,1H3
- InChI Key: OOEMRUPOYZWGEK-UHFFFAOYSA-N
- SMILES: O(C1C=CC=C(C=1)[N+](=O)[O-])C1=CC=CC(C(C)=O)=C1
Computed Properties
- Exact Mass: 257.06883
- Monoisotopic Mass: 257.06880783g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 19
- Rotatable Bond Count: 3
- Complexity: 339
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 2.9
- Topological Polar Surface Area: 72.1?2
Experimental Properties
- PSA: 69.44
Ethanone, 1-[3-(3-nitrophenoxy)phenyl]- Related Literature
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Amit Kumar Majhi,Subbarao Kanchi,V. Venkataraman,K. G. Ayappa,Prabal K. Maiti Soft Matter, 2015,11, 8632-8640
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J. Zagora,M. Vosla?,L. Schreiberová,I. Schreiber Phys. Chem. Chem. Phys., 2002,4, 1284-1291
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Norihito Fukui,Keisuke Fujimoto,Hideki Yorimitsu,Atsuhiro Osuka Dalton Trans., 2017,46, 13322-13341
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Chung-Sung Yang,Mong-Shian Shih,Fang-Yi Chang New J. Chem., 2006,30, 729-735
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Jacob S. Jordan,Evan R. Williams Analyst, 2021,146, 2617-2625
61435-06-1 (Ethanone, 1-[3-(3-nitrophenoxy)phenyl]-) Related Products
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